Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.62 |
| ▸ | TRIM24 | O15164 | 2/20 | 0.35 |
| ▸ | TRIM33 | Q9UPN9 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Tert-Butyl Formate SCHEMBL27648208 | 0.93 | TDP1 (0.59) | TDP1TRIM24TRIM33ALDH1A1 | |
| Tert-Butyl Formate SCHEMBL17956858 | 0.83 | TDP1 (0.52) | TDP1 | |
| Tert-Butyl Formate SCHEMBL28323569 | 0.82 | TDP1 (0.81) | TDP1 | |
| Cycloheptane SCHEMBL28317354 | 0.82 | TDP1 (0.81) | TDP1 | |
| Tert-Butyl Formate SCHEMBL27570851 | 0.82 | TDP1 (0.81) | TDP1 | |
| Tert-Butyl Formate SCHEMBL27590712 | 0.82 | TDP1 (0.81) | TDP1 | |
| Tert-Butyl Formate SCHEMBL27889355 | 0.82 | TDP1 (0.81) | TDP1 | |
| Tert-Butyl Formate SCHEMBL28074605 | 0.82 | TDP1 (0.81) | TDP1 | |
| Cyclooctane SCHEMBL21693719 | 0.82 | TDP1 (0.81) | TDP1 | |
| Tert-Butyl Formate SCHEMBL28750430 | 0.81 | TDP1 (0.50) | TDP1ALDH1A1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102762102-A | Novel oxadiazole compounds | ABBOTT LAB | 2012-10-31 | — | — | CN | disclosed |